methyl 4-[3-(4-bromophenyl)-5-tert-butyl-2-(diethylcarbamoyloxy)phenyl]benzoate

Systemtic Name: methyl 4-[3-(4-bromophenyl)-5-tert-butyl-2-(diethylcarbamoyloxy)phenyl]benzoate Openeye Name: methyl 4-[3-(4-bromophenyl)-5-tert-butyl-2-(diethylcarbamoyloxy)phenyl]benzoate CAS Name: 4-[3-(4-bromophenyl)-5-tert-butyl-2-[diethylamino(oxo)methoxy]phenyl]benzoic acid methyl ester IUPAC Name: methyl 4-[3-(4-bromophenyl)-5-tert-butyl-2-(diethylcarbamoyloxy)phenyl]benzoate Traditional Name: 4-[3-(4-bromophenyl)-5-tert-butyl-2-(diethylcarbamoyloxy)phenyl]benzoic acid methyl ester Formula: C29H32BrNO4 MolecularWeight: 538.47268

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)OC1=C(C=C(C=C1C2=CC=C(C=C2)C(=O)OC)C(C)(C)C)C3=CC=C(C=C3)Br

Isomeric SMILES

CCN(CC)C(=O)OC1=C(C=C(C=C1C2=CC=C(C=C2)C(=O)OC)C(C)(C)C)C3=CC=C(C=C3)Br

InChI

InChI=1S/C29H32BrNO4/c1-7-31(8-2)28(33)35-26-24(19-9-11-21(12-10-19)27(32)34-6)17-22(29(3,4)5)18-25(26)20-13-15-23(30)16-14-20/h9-18H,7-8H2,1-6H3